4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline

C17H29N3 — CID 105313006

IUPAC4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline
SMILESCCC1CCC(C(NN)c2ccc(N(C)C)cc2)CC1
InChIInChI=1S/C17H29N3/c1-4-13-5-7-14(8-6-13)17(19-18)15-9-11-16(12-10-15)20(2)3/h9-14,17,19H,4-8,18H2,1-3H3
InChIKeySUJCGEVOZGLWRS-UHFFFAOYSA-N
MW275.44 g/mol
LogP3.47
Rot. Bonds5

About 4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline

4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline (PubChem CID 105313006) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is 4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline.

Molecular Properties

Compound Name4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline
PubChem CID105313006
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC Name4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline
SMILESCCC1CCC(C(NN)c2ccc(N(C)C)cc2)CC1
InChIInChI=1S/C17H29N3/c1-4-13-5-7-14(8-6-13)17(19-18)15-9-11-16(12-10-15)20(2)3/h9-14,17,19H,4-8,18H2,1-3H3
InChIKeySUJCGEVOZGLWRS-UHFFFAOYSA-N
XLogP3.47
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(4-tert-butylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 105231567
[(4-cyclopropyloxyphenyl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 105231410
[(3-ethylcyclopentyl)-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105233695
[(4-ethylcyclohexyl)-naphthalen-2-ylmethyl]hydrazine
CID 105213365
[(3-chloro-4-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 105313068
[(4-ethylcyclohexyl)-(3-iodophenyl)methyl]hydrazine
CID 105313007
[(4-butylcyclohexyl)-(4-methylphenyl)methyl]hydrazine
CID 105285296
[(4-ethylcyclohexyl)-thiophen-2-ylmethyl]hydrazine
CID 105193634
[(4-tert-butylcyclohexyl)-(4-ethylphenyl)methyl]hydrazine
CID 105232777
[(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 105313020
4-[cycloheptyl(propylamino)methyl]-N,N-dimethylaniline
CID 105176331
[(5-chlorofuran-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 106694480

Frequently Asked Questions

What is the IUPAC name of 4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline?
The IUPAC name of 4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline (CID 105313006) is 4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline.
What is the SMILES notation for 4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline?
The canonical SMILES for 4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline is CCC1CCC(C(NN)c2ccc(N(C)C)cc2)CC1.
What is the InChIKey of 4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline?
The InChIKey is SUJCGEVOZGLWRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-4-13-5-7-14(8-6-13)17(19-18)15-9-11-16(12-10-15)20(2)3/h9-14,17,19H,4-8,18H2,1-3H3.
What are the key properties of 4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline?
4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline has a molecular weight of 275.44 g/mol, XLogP of 3.47, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline is sourced from PubChem (CID 105313006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).